SCHEMBL3369918

SCHEMBL3369918

Cc1cccc(COCCCOCc2nc(-c3ccc(Oc4ccccc4)cc3)oc2C)c1C(=O)O.Cc1oc(-c2ccc(Oc3ccccc3)cc2)nc1CI

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 13/20 0.43
PPARA Q07869 12/20 0.43
TP53 P04637 2/20 0.42
FFAR1 O14842 1/20 0.42
MAPT P10636 2/20 0.42
KDR P35968 1/20 0.41
PPARD Q03181 2/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3292476 0.96 PPARG (0.46) PPARGPPARATP53FFAR1MAPT
SCHEMBL3371224 0.91 PPARG (0.43) PPARGPPARATP53FFAR1MAPT
SCHEMBL3426842 0.90 PPARA (0.43) PPARGPPARATP53PPARD
SCHEMBL3370847 0.89 PPARG (0.45) PPARGPPARATP53MAPTPPARD
SCHEMBL13114657 0.88 KDM4E (0.48) PPARGPPARATP53FFAR1KDR
SCHEMBL3424581 0.88 PPARA (0.43) PPARGPPARATP53PPARD
SCHEMBL3369646 0.87 ALDH1A1 (0.50) PPARGPPARATP53MAPT
SCHEMBL13295227 0.86 KDM4E (0.48) PPARGPPARATP53FFAR1KDR
SCHEMBL3298881 0.86 PPARG (0.46) PPARGPPARATP53FFAR1MAPT
SCHEMBL3372963 0.85 ALDH1A1 (0.50) PPARGPPARATP53MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1902039-B1 6-OXAZOL-4-YLMETHOXY-ALKOXYMETHYL SUBSTITUTED BENZOIC ACID DERIVATIVES FORMING PPAR LIGANDS, METHODS FOR PRODUCTION AND THE USE THEREOF IN THE FORM OF DRUGS SANOFI AVENTIS (FR) 2010-10-13 EP disclosed
EP-1902039-A1 6-OXAZOL-4-YLMETHOXY-ALKOXYMETHYL SUBSTITUTED BENZOIC ACID DERIVATIVES FORMING PPAR LIGANDS, METHODS FOR PRODUCTION AND THE USE THEREOF IN THE FORM OF DRUGS Sanofi-Aventis (FR) 2008-03-26 EP disclosed
WO-2007000235-A1 6-OXAZOL-4-YLMETHOXY-ALKOXYMETHYL SUBSTITUTED BENZOIC ACID DERIVATIVES FORMING PPAR LIGANDS, METHODS FOR PRODUCTION AND THE USE THEREOF IN THE FORM OF DRUGS SANOFI-AVENTIS (DE) 2007-01-04 WO disclosed